methylsulfinylmethane

C8H24O4S4 — CID 21183497

IUPACmethylsulfinylmethane
SMILESCS(C)=O.CS(C)=O.CS(C)=O.CS(C)=O
InChIInChI=1S/4C2H6OS/c4*1-4(2)3/h4*1-2H3
InChIKeyHWSUEOIZJCEJPA-UHFFFAOYSA-N
MW312.54 g/mol
LogP-0.02
Rot. Bonds

About methylsulfinylmethane

methylsulfinylmethane (PubChem CID 21183497) has the molecular formula C8H24O4S4 and a molecular weight of 312.54 g/mol. Its IUPAC name is methylsulfinylmethane.

Molecular Properties

Compound Namemethylsulfinylmethane
PubChem CID21183497
Molecular FormulaC8H24O4S4
Molecular Weight312.54 g/mol
Exact Mass312.06
IUPAC Namemethylsulfinylmethane
SMILESCS(C)=O.CS(C)=O.CS(C)=O.CS(C)=O
InChIInChI=1S/4C2H6OS/c4*1-4(2)3/h4*1-2H3
InChIKeyHWSUEOIZJCEJPA-UHFFFAOYSA-N
XLogP-0.02
TPSA68.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.54
LogP ≤ 5-0.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methylsulfinylmethane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methylsulfinylmethane?
The IUPAC name of methylsulfinylmethane (CID 21183497) is methylsulfinylmethane.
What is the SMILES notation for methylsulfinylmethane?
The canonical SMILES for methylsulfinylmethane is CS(C)=O.CS(C)=O.CS(C)=O.CS(C)=O.
What is the InChIKey of methylsulfinylmethane?
The InChIKey is HWSUEOIZJCEJPA-UHFFFAOYSA-N. The full InChI is InChI=1S/4C2H6OS/c4*1-4(2)3/h4*1-2H3.
What are the key properties of methylsulfinylmethane?
methylsulfinylmethane has a molecular weight of 312.54 g/mol, XLogP of -0.02, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methylsulfinylmethane is sourced from PubChem (CID 21183497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).